>compound Lomefloxacin
>formula C17H19F2N3O3
>parentmass 352.148672444287
>charge 1

>ms1peaks
308.158856103319 0.626066
334.138170747564 2.50706
352.148672444287 100.0
352.315200360587 4.37786
352.375146706658 1.81199
352.42164189472 1.00864
352.498152947811 0.784765
352.546076682347 0.829204
352.600235682971 0.627753
352.639299229892 0.606327
352.731899498512 0.583874
352.81690808185 0.519052

>collision 10.0
265.113822781376 2.85226
288.149543362436 0.507331
308.155615241483 7.93453
334.134914893976 26.8441
334.299322924608 0.659265
352.144582136041 100.0
352.314840815066 3.97126
352.376173825053 1.83566
352.457906964525 0.728614
352.498266724428 0.672227
352.544113113859 0.784516
352.608712719656 0.572682
352.680466032462 0.533873

>collision 20.0
44.0521957183317 1.05481
84.083113451423 0.776731
223.071152213593 0.57718
225.087264865617 0.715145
237.085183854925 1.3442
243.117097655562 0.503488
249.050619683864 0.549316
251.100870765036 3.99964
258.141743654502 0.876997
265.116815203913 20.9925
286.102371467859 0.513616
288.15217005675 3.11342
291.122363219751 1.49001
306.126168423531 0.961698
308.158834448521 19.5601
314.131476820824 3.37535
334.137828035149 100.0
334.299146893218 3.79789
334.358727556881 1.53282
334.477965756473 0.672657
334.524426132758 0.707844
334.609108110255 0.565498
334.716927292983 0.52658
334.794457141926 0.508519
335.139135338259 0.583
352.148833041921 27.1195
352.314427736447 0.547076

>collision 40.0
41.0408815649186 2.98948
42.0364133303512 3.93186
43.0559934332618 1.01432
44.0521803867514 21.7421
55.056145919696 0.744041
56.0521728702196 3.47526
57.0688907791734 0.674835
58.0679854290006 6.83943
67.057080285752 0.619565
68.0523731623212 0.668564
70.0678212871754 11.5005
71.0751033014508 0.597272
72.083548019405 2.07238
82.067598181653 2.42604
83.0643618849136 0.501255
84.0830995961186 5.28954
97.07914095547 0.966323
98.0865782016212 0.822554
134.042368882656 1.28528
147.049036108739 0.684199
148.057147822201 1.5841
149.054397979959 0.638153
152.034738388151 1.3066
153.043200313876 0.640749
154.051417944795 1.12521
155.062010099197 1.41084
160.055669456476 0.86917
161.056454258216 1.88136
162.040699391515 1.63924
166.044246173422 2.75751
167.0491549036 1.30441
168.0634265531 1.52266
169.076929548597 1.13118
173.053268434195 2.0014
174.062004238098 2.62447
175.068171112926 2.58275
176.058945999978 1.71714
177.075395924714 0.530311
179.047270925233 1.8324
180.04752345091 1.2011
181.046006870422 2.60106
182.046990542708 2.42122
183.086091504891 0.867238
185.060625064829 0.619642
186.063204751844 0.808361
187.067585702588 3.87452
188.065541753033 3.18233
189.071874179362 1.67398
190.069116130435 1.64107
191.081494640527 0.750011
192.049790891428 0.855458
193.053799102461 2.07867
194.067144521838 19.7977
195.061308471636 8.44724
196.054664465024 3.92396
197.058332753772 4.68926
199.071573175824 0.713427
200.066342684336 1.10413
201.077384340894 2.22873
202.058872550681 5.31982
203.081607038251 8.82693
204.08016838503 0.740335
205.035895653517 1.67608
206.037474234049 0.919923
207.073742816966 3.76584
208.068733815034 7.80061
209.061006047582 7.74828
210.100113737214 2.51644
213.082739618609 0.766259
214.080705112702 1.153
215.051297528053 5.33885
216.065054254708 5.92013
217.077674215262 9.66563
218.083407050646 1.09873
219.085704940819 1.52342
220.046371922855 2.49945
221.054924155773 4.08971
222.068143377647 14.07
223.07190203822 22.4188
224.078064547471 3.98401
225.085980592052 3.6493
228.093591099688 3.16313
229.087920979196 2.05349
230.10930871672 14.2243
231.091276919676 2.36397
232.089968697389 0.67306
233.045702359286 1.06866
234.094514601779 1.01796
235.069015753316 10.6604
236.075857091484 9.59247
237.085688846071 76.413
237.22442227116 1.26603
237.272058604458 0.701325
238.100859172517 2.62703
239.11270567232 0.511101
242.097222174319 1.83352
243.117526708916 54.7489
243.256695208509 1.01417
244.054519572369 25.3621
244.191509288057 0.609925
245.100944246648 3.32883
246.106701511172 1.12837
247.110540524274 1.02911
249.048967528636 84.3913
249.190114100428 1.5628
249.235278221942 0.747829
250.091704451381 2.17274
251.100518193013 14.3238
252.079867781883 1.30739
256.07371380196 1.10901
257.101292305072 9.19865
258.140096467644 24.7517
259.108821961876 0.717187
260.119034335464 0.506463
261.04915705108 1.22438
262.099051578445 1.33091
263.065142275113 21.8934
265.116476749048 54.4342
265.260581591558 0.912154
266.098323132659 2.75903
269.075157328791 0.59526
270.070701039835 3.87292
271.079044262595 9.83085
272.084589223467 19.2694
273.113632250306 0.594218
277.079102177163 2.02177
284.084430358713 1.11798
285.092939476439 5.71491
286.100653257742 41.3493
286.251481273431 0.632049
288.151195765446 1.05481
289.068021437091 0.906987
290.075855072027 0.948127
291.103649292989 6.00636
292.091636800532 0.876994
294.125969127858 0.817106
299.107670751256 1.6738
304.089054609024 0.968116
306.106649574921 40.7086
306.2628329331 0.71858
314.131315824555 51.5586
314.288545148394 0.829336
334.138004412367 100.0
334.299121775446 1.90979
334.355125689766 0.913778
334.434584332194 0.643687
334.493045788871 0.550275
334.678659925782 0.533247

